Chem
J-GLOBAL ID：200907020301498560   Nikkaji number：J2.774.366H

(3S)-6-Hydroxy-3-isopropenyl-heptanoate

(3S)-6-ヒドロキシ-3-イソプロペニルヘプタン酸
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C10H18O3
Molecular formula furigana： C10-H18-O3
Molecular weight： 186.251
InChI： InChI=1S/C10H18O3/c1-7(2)9(6-10(12)13)5-4-8(3)11/h8-9,11H,1,4-6H2,2-3H3,(H,12,13)/t8?,9-/m0/s1
InChI key： NQYDFAGFKCSWGI-GKAPJAKFSA-N
SMILES： CC(O)CC[C@@H](CC(=O)O)C(=C)C
Systematic name  (3)：
  • (3S)-6-ヒドロキシ-3-イソプロペニルヘプタン酸
  • (3S)-6-ヒドロキシ-3-(プロパ-1-エン-2-イル)ヘプタン酸
  • (3S)-6-hydroxy-3-(prop-1-en-2-yl)heptanoic acid
Other name (2)：
  • (3S)-6-Hydroxy-3-isopropenylheptanoic acid
  • (3S)-6-Hydroxy-3-isopropenyl-heptanoate
KEGG COMPOUND： C11417
Thsaurus map：
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